[1-(cyclopentylmethylsulfonyl)-3-(3-phenylpropanoylamino)propan-2-yl] dihydrogen phosphate

Systemtic Name: [1-(cyclopentylmethylsulfonyl)-3-(3-phenylpropanoylamino)propan-2-yl] dihydrogen phosphate Openeye Name: [1-(cyclopentylmethylsulfonylmethyl)-2-(3-phenylpropanoylamino)ethyl] dihydrogen phosphate CAS Name: [1-(cyclopentylmethylsulfonyl)-3-[(1-oxo-3-phenylpropyl)amino]propan-2-yl] dihydrogen phosphate IUPAC Name: [1-(cyclopentylmethylsulfonyl)-3-(3-phenylpropanoylamino)propan-2-yl] dihydrogen phosphate Traditional Name: [1-(cyclopentylmethylsulfonylmethyl)-2-(hydrocinnamoylamino)ethyl] dihydrogen phosphate Formula: C18H28NO7PS MolecularWeight: 433.456181

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CS(=O)(=O)CC(CNC(=O)CCC2=CC=CC=C2)OP(=O)(O)O

Isomeric SMILES

C1CCC(C1)CS(=O)(=O)CC(CNC(=O)CCC2=CC=CC=C2)OP(=O)(O)O

InChI

InChI=1S/C18H28NO7PS/c20-18(11-10-15-6-2-1-3-7-15)19-12-17(26-27(21,22)23)14-28(24,25)13-16-8-4-5-9-16/h1-3,6-7,16-17H,4-5,8-14H2,(H,19,20)(H2,21,22,23)